이름: 6-[5-(1-benzyloxycarbonyl-1-methyl-ethyl)-pyridin-3-yl]-3,4-dihydro-2H-[1,8]naphthyridine-1-carboxylic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1CCCc2cc(-c3cncc(C(C)(C)C(=O)OCc4ccccc4)c3)cnc21Molecular Processing
Molecular formula
C29H33N3O4
Molecular weight
487.6
Exact mass
487.2471
XLogP
5.85
TPSA
81.62
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
138.63
Supplementary Information
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